Explore small molecules, screening libraries, and tool compounds for discovery research. Browse by target, pathway, or ligand family to quickly find inhibitors, agonists, and chemical probes, with searchable structure/CAS data and supporting documents (SDS/COA where available).
By Target / Pathway / Disease
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Ready-to-screen compound libraries and focused sets for hit discovery. Browse libraries by target class, pathway, scaffold, or application, and review size, format, and compound information to build screening panels.Customize Your Screening Library to choose compounds, format, and volume, and we’ll prepare a ready-to-use set for you.Customize Your Screening Library
Ligand families
24,635Navigate small molecules by ligand family or scaffold to build focused sets and explore structure–activity relationships. This category groups related chemotypes, helping you select analogs, fragments, and tool molecules for discovery research.
ADC-focused building blocks and tools to support antibody–drug conjugate research. Explore payloads, linkers, conjugation reagents, and related small-molecule components (where available) for designing and evaluating ADC constructs.
PROTAC
2,814PROTAC and targeted protein degradation tools for discovery research. Browse degrader-related ligands, linkers, and building blocks (where available) to assemble or screen PROTAC designs, with clear identifiers for efficient selection.
By Signaling Pathways
102,621Explore pathway-focused tool compounds to study and modulate key signaling cascades. Browse small molecules grouped by signaling pathway to support mechanism studies, phenotypic assays, and target validation, with clear identifiers for fast searching.
By Target (DTO)
19,694Find bioactive small molecules organized by protein target (DTO). Quickly locate tool compounds for specific targets and compare identifiers such as structure, CAS, and synonyms—plus supporting documents —to build screening and validation sets.
By Disease (DOID)
8,779Shop small molecules and tool compounds organized by disease area (DOID). Discover chemical probes, libraries, and related products mapped to therapeutic areas to help assemble compound sets for screening, pathway exploration, and model studies.
Products
- (±)-BAYK8644, Activator of Ca v1.1;Activator of Ca v1.2;Activator of Ca v1.3;Activator of Ca v1.4Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. 10mM in DMSO● In Stock — US warehouse, ships to EU* Item #: B425631View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- methyl 2,6-dimethyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate
- SMILES
- CC1=C(C(C(=C(N1)C)[N+](=O)[O-])C2=CC=CC=C2C(F)(F)F)C(=O)OC
- InChIKey
- ZFLWDHHVRRZMEI-UHFFFAOYSA-N
- InChI
- 1S/C16H15F3N2O4/c1-8-12(15(22)25-3)13(14(21(23)24)9(2)20-8)10-6-4-5-7-11(10)16(17,18)19/h4-7,13,20H,1-3H3
- Synonyms
- 71145-03-4|Bay K 8644|(+/-)-BAY K 8644|methyl 2,6-dimethyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-...
- (±)-Citronellal10mM in DMSO● In Stock — US warehouse, ships to EU* Item #: C420495View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 3,7-dimethyloct-6-enal
- SMILES
- CC(CCC=C(C)C)CC=O
- InChIKey
- NEHNMFOYXAPHSD-UHFFFAOYSA-N
- InChI
- 1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,8,10H,4,6-7H2,1-3H3
- Synonyms
- 3,7-dimethyloct-6-en-1-al | cymbopogon winterianus | EINECS 203-376-6 | 3,7-Dimethyloct-6-enal 6-Octenal | AKOS000121...
- (±)-U-50488 hydrochlorideCAS: 67197-96-0 Formula: C19H26Cl2N2O.HCl Molecular Weight: 405.79Solid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%◐ .Made to order · 8–12 wks Item #: U288152View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 2-(3,4-dichlorophenyl)-N-methyl-N-[(1R,2R)-2-pyrrolidin-1-ylcyclohexyl]acetamide;hydrochloride
- SMILES
- CN(C1CCCCC1N2CCCC2)C(=O)CC3=CC(=C(C=C3)Cl)Cl.Cl
- InChIKey
- KGMMGVIYOHGOKQ-JAXOOIEVSA-N
- InChI
- 1S/C19H26Cl2N2O.ClH/c1-22(19(24)13-14-8-9-15(20)16(21)12-14)17-6-2-3-7-18(17)23-10-4-5-11-23;/h8-9,12,17-18H,2-7,10-11,13H2,1H3;1H/t17-,18-;/m1./s1
- Synonyms
- (±)-Trans-(1R,2R)-U-50488 hydrochloride
- (±)-Verapamil hydrochloride, Voltage-gated L-type calcium channel blockerCAS: 152-11-4 EC Number: 205-800-5 PubChem CID: 62969 Formula: C27H38N2O4·HCl Molecular Weight: 491.0610mM in DMSO● In Stock — US warehouse, ships to EU* Item #: V421803View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 2-(3,4-dimethoxyphenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-2-propan-2-ylpentanenitrile;hydrochloride
- SMILES
- CC(C)C(CCCN(C)CCC1=CC(=C(C=C1)OC)OC)(C#N)C2=CC(=C(C=C2)OC)OC.Cl
- InChIKey
- DOQPXTMNIUCOSY-UHFFFAOYSA-N
- InChI
- 1S/C27H38N2O4.ClH/c1-20(2)27(19-28,22-10-12-24(31-5)26(18-22)33-7)14-8-15-29(3)16-13-21-9-11-23(30-4)25(17-21)32-6;/h9-12,17-18,20H,8,13-16H2,1-7H3;1H
- Synonyms
- Verapamil hydrochloride|152-11-4|Verapamil HCl|Manidon|Calcan hydrochloride|Cardibeltin|Cordilox|Verelan|Cardiabeltin...
- (±)-Vesamicol hydrochlorideCAS: 120447-62-3 Formula: C17H25NO·HCl Molecular Weight: 295.85● In Stock — US warehouse, ships to EU* Item #: V288178View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 2-(4-phenylpiperidin-1-yl)cyclohexan-1-ol;hydrochloride
- SMILES
- C1CCC(C(C1)N2CCC(CC2)C3=CC=CC=C3)O.Cl
- InChIKey
- XJNUHVMJVWOYCW-UHFFFAOYSA-N
- InChI
- 1S/C17H25NO.ClH/c19-17-9-5-4-8-16(17)18-12-10-15(11-13-18)14-6-2-1-3-7-14;/h1-3,6-7,15-17,19H,4-5,8-13H2;1H
- Synonyms
- 2-(4-phenylpiperidin-1-yl)cyclohexan-1-ol hydrochloride | LP01228 | Tox21_501228 | L(-)-vesamicol hydrochloride | Pha...
- (±)-Jasmonic acidCAS: 77026-92-7 Formula: C12H18O3 Molecular Weight: 210.27Suitable for plant cell culture ? Plant cell-culture grade — formulated for plant tissue and cell cultures. Use in plant biotechnology, callus, and suspension culture work.◐ .Made to order · 8–12 wks Item #: J304598View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 2-[(1R,2R)-3-oxo-2-[(Z)-pent-2-enyl]cyclopentyl]acetic acid
- SMILES
- CCC=CCC1C(CCC1=O)CC(=O)O
- InChIKey
- ZNJFBWYDHIGLCU-HWKXXFMVSA-N
- InChI
- 1S/C12H18O3/c1-2-3-4-5-10-9(8-12(14)15)6-7-11(10)13/h3-4,9-10H,2,5-8H2,1H3,(H,14,15)/b4-3-/t9-,10-/m1/s1
- Synonyms
- Cyclopentaneacetic acid, 3-oxo-2-[(2Z)-2-penten-1-yl]-, (1R,2R)- | (1R,2R)-3-OXO-2-(2Z)-2-PENTENYLCYCLOPENTANEACETIC ...
- (±)-Dropropizine10mM in DMSO● In Stock — US warehouse, ships to EU* Item #: D422157View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 3-(4-phenylpiperazin-1-yl)propane-1,2-diol
- SMILES
- C1CN(CCN1CC(CO)O)C2=CC=CC=C2
- InChIKey
- PTVWPYVOOKLBCG-UHFFFAOYSA-N
- InChI
- 1S/C13H20N2O2/c16-11-13(17)10-14-6-8-15(9-7-14)12-4-2-1-3-5-12/h1-5,13,16-17H,6-11H2
- Synonyms
- HMS1921B07 | NSC-757820 | Prestwick1_000245 | Dropropizinum [INN-Latin] | NCGC00018230-05 | rac Dropropizine | 3-(4-P...
- (±)-Gossypol from cotton seedsMoligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. 10mM in DMSO● In Stock — US warehouse, ships to EU* Item #: G423137View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 7-(8-formyl-1,6,7-trihydroxy-3-methyl-5-propan-2-ylnaphthalen-2-yl)-2,3,8-trihydroxy-6-methyl-4-propan-2-ylnaphthalene-1-carbaldehyde
- SMILES
- CC1=CC2=C(C(=C(C(=C2C(C)C)O)O)C=O)C(=C1C3=C(C4=C(C=C3C)C(=C(C(=C4C=O)O)O)C(C)C)O)O
- InChIKey
- QBKSWRVVCFFDOT-UHFFFAOYSA-N
- InChI
- 1S/C30H30O8/c1-11(2)19-15-7-13(5)21(27(35)23(15)17(9-31)25(33)29(19)37)22-14(6)8-16-20(12(3)4)30(38)26(34)18(10-32)24(16)28(22)36/h7-12,33-38H,1-6H3
- Synonyms
- gossypol|303-45-7|90141-22-3|(-)-Gossypol|Pogosin|(+)-Gossypol|Tash 1|(R)-Gossypol|(R)-(-)-Gossypol|No Fertil|AT 101|...
- (±)17-HDHACAS: 90780-52-2 Formula: C22H32O3 Molecular Weight: 344.49Liquid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98% 100μg/ml in ethanol◐ .Made to order · 8–12 wks Item #: H345262View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- (4Z,7Z,10Z,13Z,15E,19Z)-17-hydroxydocosa-4,7,10,13,15,19-hexaenoic acid
- SMILES
- CCC=CCC(C=CC=CCC=CCC=CCC=CCCC(=O)O)O
- InChIKey
- SWTYBBUBEPPYCX-VIIQGJSXSA-N
- InChI
- show more
- Synonyms
- (4Z,7Z,10Z,13Z,15E,19Z)-17-Hydroxydocosahexaenoic acid | LMFA07010952 | SR-01000946909-1 | 17-HDoHE | SCHEMBL10026728...
- 1,1,1,1-Kestohexaose● In Stock — US warehouse, ships to EU* Item #: K412899View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- show more
- SMILES
- C(C1C(C(C(C(O1)OC2(C(C(C(O2)CO)O)O)COC3(C(C(C(O3)CO)O)O)COC4(C(C(C(O4)CO)O)O)COC5(C(C(C(O5)CO)O)O)COC6(C(C(C(O6)CO)O)O)CO)O)O)O)O
- InChIKey
- BWRYDXSZCCQXIF-TWMOFSFSSA-N
- InChI
- show more
- Synonyms
- α-D-Glucopyranoside,O-β-D-fructofuranosyl-(2→1)-O-β-D-fructofuranosyl-(2→1)-O-β-D-fructofuranosyl-(2�...
- 1,1,1,1-Kestohexaose10mM in DMSO● In Stock — US warehouse, ships to EU* Item #: K425168View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- show more
- SMILES
- C(C1C(C(C(C(O1)OC2(C(C(C(O2)CO)O)O)COC3(C(C(C(O3)CO)O)O)COC4(C(C(C(O4)CO)O)O)COC5(C(C(C(O5)CO)O)O)COC6(C(C(C(O6)CO)O)O)CO)O)O)O)O
- InChIKey
- BWRYDXSZCCQXIF-TWMOFSFSSA-N
- InChI
- show more
- Synonyms
- α-D-Glucopyranoside,O-β-D-fructofuranosyl-(2→1)-O-β-D-fructofuranosyl-(2→1)-O-β-D-fructofuranosyl-(2�...
- (−)-Nicotine Mono TartrateCAS: 6550-19-2 Formula: C14H20N2O6 Molecular Weight: 312.32Solid ≥98%● In Stock — US warehouse, ships to EU* Item #: N331364View ProductPricing & Pack Sizes
Technical Identifiers
- SMILES
- CN1CCC[C@H]1C2=CN=CC=C2.C(C(C(=O)O)O)(C(=O)O)O
- Synonyms
- 3-[(2S)-1-Methyl-2-pyrrolidinyl]pyridine (2R,3R)-2,3-dihydroxybutanedioate (1:1) | (S)-(-)-Nicotine Mono Tartrate | S...
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Frequently Asked Questions
What does the By Target/Pathway/Disease listing cover?
It groups compounds associated with targets in By Target/Pathway/Disease, organised so you can move from the pathway to an individual target and then to a specific chemotype. Each entry carries structure, CAS number, and reported activity.
How is By Target/Pathway/Disease organised?
By Target/Pathway/Disease is broken down into Compound Libraries, PROTACs, molecular glues and other degraders and Antibody-drug Conjugates(ADC). Compounds acting on more than one node appear under each relevant target.
How do I choose compounds for By Target/Pathway/Disease research?
For By Target/Pathway/Disease, pick a well-characterised reference compound for the node you want to perturb, and pair it with a structurally unrelated compound hitting the same target — that is the cleanest way to separate pathway effects from off-target ones. Check potency, selectivity, and cell permeability against your assay format. All products are supplied for professional research and development use only, and are not for use in humans, animals, diagnostics, or therapy.
How do I find a specific compound within By Target/Pathway/Disease?
Search By Target/Pathway/Disease by compound name, CAS number, or SMILES, or drill down through the target listing. Unlisted compounds and bulk quantities: [email protected]. We supply verified businesses, research institutions, universities, and government agencies.